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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-06 21:03:27 UTC
Update Date2021-09-14 15:41:43 UTC
HMDB IDHMDB0029038
Secondary Accession Numbers
  • HMDB29038
Metabolite Identification
Common NameSerylglutamic acid
DescriptionSerylglutamic acid, also known as L-ser-L-glu or serylglutamate, belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Serylglutamic acid has been detected, but not quantified in, a few different foods, such as anatidaes (Anatidae), chickens (Gallus gallus), and domestic pigs (Sus scrofa domestica). This could make serylglutamic acid a potential biomarker for the consumption of these foods. Serylglutamic acid is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. Based on a literature review very few articles have been published on Serylglutamic acid.
Structure
Data?1582753368
Synonyms
ValueSource
L-Ser-L-gluChEBI
SEChEBI
Serinyl-glutamateChEBI
Serinyl-glutamic acidGenerator
SerylglutamateGenerator
L-Seryl-L-glutamateHMDB
L-Seryl-L-glutamic acidHMDB
N-L-Seryl-L-glutamateHMDB
N-L-Seryl-L-glutamic acidHMDB
N-SerylglutamateHMDB
N-Serylglutamic acidHMDB
S-e DipeptideHMDB
SE dipeptideHMDB
Ser-gluHMDB
Serine glutamate dipeptideHMDB
Serine glutamic acid dipeptideHMDB
Serine-glutamate dipeptideHMDB
Serine-glutamic acid dipeptideHMDB
SerinylglutamateHMDB
Serinylglutamic acidHMDB
Seryl-glutamateHMDB
Seryl-glutamic acidHMDB
Serylglutamic acidChEBI
Chemical FormulaC8H14N2O6
Average Molecular Weight234.208
Monoisotopic Molecular Weight234.085186179
IUPAC Name(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]pentanedioic acid
Traditional Name(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]pentanedioic acid
CAS Registry Number6403-16-3
SMILES
N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI Identifier
InChI=1S/C8H14N2O6/c9-4(3-11)7(14)10-5(8(15)16)1-2-6(12)13/h4-5,11H,1-3,9H2,(H,10,14)(H,12,13)(H,15,16)/t4-,5-/m0/s1
InChI KeyLAFKUZYWNCHOHT-WHFBIAKZSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentDipeptides
Alternative Parents
Substituents
  • Alpha-dipeptide
  • Glutamic acid or derivatives
  • N-acyl-alpha-amino acid
  • N-acyl-alpha amino acid or derivatives
  • N-acyl-l-alpha-amino acid
  • Alpha-amino acid amide
  • Serine or derivatives
  • Alpha-amino acid or derivatives
  • Dicarboxylic acid or derivatives
  • Fatty acid
  • Amino acid or derivatives
  • Carboxamide group
  • Amino acid
  • Secondary carboxylic acid amide
  • Carboxylic acid
  • Organooxygen compound
  • Organonitrogen compound
  • Organic nitrogen compound
  • Organic oxide
  • Primary aliphatic amine
  • Organopnictogen compound
  • Carbonyl group
  • Alcohol
  • Amine
  • Primary alcohol
  • Primary amine
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogP-5.12Extrapolated
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility62.1 g/LALOGPS
logP-3.6ALOGPS
logP-5.1ChemAxon
logS-0.97ALOGPS
pKa (Strongest Acidic)3.14ChemAxon
pKa (Strongest Basic)7.85ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count7ChemAxon
Hydrogen Donor Count5ChemAxon
Polar Surface Area149.95 ŲChemAxon
Rotatable Bond Count7ChemAxon
Refractivity50.13 m³·mol⁻¹ChemAxon
Polarizability21.49 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+152.41530932474
DeepCCS[M-H]-150.0230932474
DeepCCS[M-2H]-182.96530932474
DeepCCS[M+Na]+158.45630932474

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Serylglutamic acidN[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O3253.7Standard polar33892256
Serylglutamic acidN[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O1942.8Standard non polar33892256
Serylglutamic acidN[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O2324.1Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Serylglutamic acid,1TMS,isomer #1C[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O2137.8Semi standard non polar33892256
Serylglutamic acid,1TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O2183.5Semi standard non polar33892256
Serylglutamic acid,1TMS,isomer #3C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO2174.5Semi standard non polar33892256
Serylglutamic acid,1TMS,isomer #4C[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O2205.3Semi standard non polar33892256
Serylglutamic acid,1TMS,isomer #5C[Si](C)(C)N(C(=O)[C@@H](N)CO)[C@@H](CCC(=O)O)C(=O)O2151.2Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #1C[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2156.0Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #10C[Si](C)(C)N([C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2352.6Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #11C[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2225.4Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #2C[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2136.1Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #3C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O2206.2Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #4C[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2144.9Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O[Si](C)(C)C2170.4Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #6C[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2231.9Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CO)[Si](C)(C)C2139.2Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #8C[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2227.8Semi standard non polar33892256
Serylglutamic acid,2TMS,isomer #9C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@@H](N)CO)[Si](C)(C)C2149.3Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #1C[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2180.2Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O2359.1Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #11C[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2203.7Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C2352.7Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #13C[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2225.6Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #14C[Si](C)(C)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[C@@H](CCC(=O)O)C(=O)O2321.1Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #2C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O2216.8Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #3C[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2151.8Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #4C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C2218.2Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #5C[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2167.5Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #6C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2357.5Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #7C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C2200.7Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #8C[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2247.4Semi standard non polar33892256
Serylglutamic acid,3TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@@H](N)CO)[Si](C)(C)C2154.7Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #1C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2232.1Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #1C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C2258.8Standard non polar33892256
Serylglutamic acid,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2325.3Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2399.0Standard non polar33892256
Serylglutamic acid,4TMS,isomer #11C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2358.9Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #11C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2360.6Standard non polar33892256
Serylglutamic acid,4TMS,isomer #2C[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2195.2Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #2C[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2219.0Standard non polar33892256
Serylglutamic acid,4TMS,isomer #3C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2380.8Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #3C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)N([Si](C)(C)C)[Si](C)(C)C2364.2Standard non polar33892256
Serylglutamic acid,4TMS,isomer #4C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2217.6Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #4C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C2309.2Standard non polar33892256
Serylglutamic acid,4TMS,isomer #5C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2376.4Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #5C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2334.1Standard non polar33892256
Serylglutamic acid,4TMS,isomer #6C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2230.8Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #6C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C2281.1Standard non polar33892256
Serylglutamic acid,4TMS,isomer #7C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2363.9Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #7C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2380.6Standard non polar33892256
Serylglutamic acid,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2374.0Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C2337.8Standard non polar33892256
Serylglutamic acid,4TMS,isomer #9C[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2231.7Semi standard non polar33892256
Serylglutamic acid,4TMS,isomer #9C[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2258.1Standard non polar33892256
Serylglutamic acid,5TMS,isomer #1C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2326.1Semi standard non polar33892256
Serylglutamic acid,5TMS,isomer #1C[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2374.3Standard non polar33892256
Serylglutamic acid,5TMS,isomer #2C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2228.0Semi standard non polar33892256
Serylglutamic acid,5TMS,isomer #2C[Si](C)(C)N[C@@H](CO[Si](C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C2325.0Standard non polar33892256
Serylglutamic acid,5TMS,isomer #3C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2374.6Semi standard non polar33892256
Serylglutamic acid,5TMS,isomer #3C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2417.8Standard non polar33892256
Serylglutamic acid,5TMS,isomer #4C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2401.6Semi standard non polar33892256
Serylglutamic acid,5TMS,isomer #4C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2393.1Standard non polar33892256
Serylglutamic acid,5TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2374.1Semi standard non polar33892256
Serylglutamic acid,5TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)[C@H](CO)N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C2395.9Standard non polar33892256
Serylglutamic acid,6TMS,isomer #1C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2423.5Semi standard non polar33892256
Serylglutamic acid,6TMS,isomer #1C[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C2433.7Standard non polar33892256
Serylglutamic acid,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O2401.0Semi standard non polar33892256
Serylglutamic acid,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O2443.4Semi standard non polar33892256
Serylglutamic acid,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO2424.5Semi standard non polar33892256
Serylglutamic acid,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O2465.4Semi standard non polar33892256
Serylglutamic acid,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)N(C(=O)[C@@H](N)CO)[C@@H](CCC(=O)O)C(=O)O2420.9Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2625.1Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)N([C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2804.6Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2686.6Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2607.0Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O2638.0Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2612.5Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O[Si](C)(C)C(C)(C)C2636.9Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2690.4Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@@H](N)CO)[Si](C)(C)C(C)(C)C2633.6Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2678.4Semi standard non polar33892256
Serylglutamic acid,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@@H](N)CO)[Si](C)(C)C(C)(C)C2631.7Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2846.4Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O3061.0Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2918.9Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3031.2Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2912.5Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H](CCC(=O)O)C(=O)O3012.3Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O2870.5Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2847.9Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C2861.8Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2836.0Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3016.2Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C2882.9Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2889.4Semi standard non polar33892256
Serylglutamic acid,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@@H](N)CO)[Si](C)(C)C(C)(C)C2840.6Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3084.0Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C2954.0Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3257.3Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3044.2Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3243.7Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3022.6Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3050.7Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@H](N)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2941.9Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3269.6Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3027.1Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C3098.3Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C2973.0Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3245.4Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2997.0Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3089.6Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2956.1Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3238.3Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3026.3Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3261.8Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C3021.0Standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3102.6Semi standard non polar33892256
Serylglutamic acid,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)N[C@@H](CO)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C2958.5Standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3462.8Semi standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3174.4Standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3272.7Semi standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #2CC(C)(C)[Si](C)(C)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3125.9Standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3465.4Semi standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3208.7Standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3452.5Semi standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H](C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3196.8Standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3448.2Semi standard non polar33892256
Serylglutamic acid,5TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)[C@H](CO)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C3219.5Standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Serylglutamic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Serylglutamic acid GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 10V, Positive-QTOFsplash10-02ti-6690000000-53c925531ffd53325f3a2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 20V, Positive-QTOFsplash10-03di-9820000000-2787f5f53c7dafbaef5f2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 40V, Positive-QTOFsplash10-0gvo-9300000000-9c3367aac79045071a6e2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 10V, Negative-QTOFsplash10-00m0-0590000000-ccb63572b0af814525842019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 20V, Negative-QTOFsplash10-00rj-3930000000-943b318c1b29fca8b9882019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 40V, Negative-QTOFsplash10-0btc-9400000000-e5cedfbcab4fe9390a7a2019-02-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 10V, Negative-QTOFsplash10-017i-0890000000-83cf9647733ffdb0b5fb2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 20V, Negative-QTOFsplash10-0ufr-0900000000-35cd161e777bdb1668292021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 40V, Negative-QTOFsplash10-0udi-4900000000-e1e646059b8aae1e34ca2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 10V, Positive-QTOFsplash10-000j-0890000000-213aa6ddadea625e6ecc2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 20V, Positive-QTOFsplash10-03ea-9810000000-c5162d10df0e0e389e5f2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Serylglutamic acid 40V, Positive-QTOFsplash10-08mu-9000000000-357c149717cb2d2dac4d2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB112046
KNApSAcK IDNot Available
Chemspider ID5386361
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound7023503
PDB IDNot Available
ChEBI ID74813
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Morii H, Saiki M, Konakahara T, Ishimura M: Peripheral region for core cross-beta plays important role in amyloidogenicity. Biochem Biophys Res Commun. 2006 Apr 14;342(3):808-16. Epub 2006 Feb 14. [PubMed:16499867 ]